HRID1573605

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

2 次

HCID5943

Carbon tetrachloride

CCl4

HCID82848

Ruthenium oxide (RuO2)

O2Ru

HCID167232

Periodate ion

IO4-

反应SMILES：Cc1ccccc1-c1cc(N2CCOCC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID6450815

Befetupitant

C29H29F6N3O2

PRODUCTS

产物

HCID10303207

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-41b3cd3510e8461bbf0a53b1cd921640
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

[C:47]([Cl:48])([Cl:49])([Cl:50])[Cl:51].[F:7][C:8]([c:9]1[cH:10][c:11]([C:19]([C:20](=[O:21])[N:22]([c:23]2[cH:24][n:25][c:26]([N:36]3[CH2:37][CH2:38][O:39][CH2:40][CH2:41]3)[cH:27][c:28]2-[c:29]2[c:30]([CH3:35])[cH:31][cH:32][cH:33][cH:34]2)[CH3:42])([CH3:43])[CH3:44])[cH:12][c:13]([C:15]([F:16])([F:17])[F:18])[cH:14]1)([F:45])[F:46].[I+3:1]([O-:2])([O-:3])([O-:4])[O-:5].[Na+:6].[OH2:52].[OH2:53].[Ru:54](=[O:55])=[O:56]>>[F:7][C:8]([c:9]1[cH:10][c:11]([C:19]([C:20](=[O:21])[N:22]([c:23]2[cH:24][n:25][c:26]([N:36]3[CH:37]=[CH:38][O:39][CH2:40][CH2:41]3)[cH:27][c:28]2-[c:29]2[c:30]([CH3:35])[cH:31][cH:32][cH:33][cH:34]2)[CH3:42])([CH3:43])[CH3:44])[cH:12][c:13]([C:15]([F:16])([F:17])[F:18])[cH:14]1)([F:45])[F:46]